difluoromethyl-bis(phenylmethoxy)-sulfanylidene-lambda5-phosphane

C15H15F2O2PS — CID 15273575

IUPACdifluoromethyl-bis(phenylmethoxy)-sulfanylidene-lambda5-phosphane
SMILESFC(F)P(=S)(OCc1ccccc1)OCc1ccccc1
InChIInChI=1S/C15H15F2O2PS/c16-15(17)20(21,18-11-13-7-3-1-4-8-13)19-12-14-9-5-2-6-10-14/h1-10,15H,11-12H2
InChIKeyMYXIQNQYNYQGAQ-UHFFFAOYSA-N
MW328.32 g/mol
LogP4.95
Rot. Bonds7

About difluoromethyl-bis(phenylmethoxy)-sulfanylidene-lambda5-phosphane

difluoromethyl-bis(phenylmethoxy)-sulfanylidene-lambda5-phosphane (PubChem CID 15273575) has the molecular formula C15H15F2O2PS and a molecular weight of 328.32 g/mol. Its IUPAC name is difluoromethyl-bis(phenylmethoxy)-sulfanylidene-lambda5-phosphane.

Molecular Properties

Compound Namedifluoromethyl-bis(phenylmethoxy)-sulfanylidene-lambda5-phosphane
PubChem CID15273575
Molecular FormulaC15H15F2O2PS
Molecular Weight328.32 g/mol
Exact Mass328.05
IUPAC Namedifluoromethyl-bis(phenylmethoxy)-sulfanylidene-lambda5-phosphane
SMILESFC(F)P(=S)(OCc1ccccc1)OCc1ccccc1
InChIInChI=1S/C15H15F2O2PS/c16-15(17)20(21,18-11-13-7-3-1-4-8-13)19-12-14-9-5-2-6-10-14/h1-10,15H,11-12H2
InChIKeyMYXIQNQYNYQGAQ-UHFFFAOYSA-N
XLogP4.95
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.32
LogP ≤ 54.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

zinc bis(bis(phenylmethoxy)-sulfanylidene-sulfido-λ5-phosphane)
CID 87069687
[fluoro(phenylmethoxy)phosphoryl]oxymethylbenzene
CID 14175848
benzyl tert-butyl hydrogen phosphate
CID 140989025
2,3-difluoropropoxymethylbenzene
CID 86233522
benzylsulfanyl-hydroxy-phenylmethoxy-sulfanylidene-λ5-phosphane
CID 6453024
[benzyl(chloromethoxy)phosphoryl]oxymethylbenzene
CID 57149072
bis(phenylmethoxy)phosphorylboranuide
CID 157313450
hydroxy-imino-bis(phenylmethoxy)-λ5-phosphane
CID 57159517
2-fluorobutoxymethylbenzene
CID 121368179
[[bromo(difluoro)methyl]-phenylmethoxyphosphoryl]oxymethylbenzene
CID 19751870
[(2R)-3-chloro-2-fluoropropoxy]methylbenzene
CID 69067716
dibenzyl hydrogen phosphate;silver
CID 85301331

Frequently Asked Questions

What is the IUPAC name of difluoromethyl-bis(phenylmethoxy)-sulfanylidene-lambda5-phosphane?
The IUPAC name of difluoromethyl-bis(phenylmethoxy)-sulfanylidene-lambda5-phosphane (CID 15273575) is difluoromethyl-bis(phenylmethoxy)-sulfanylidene-lambda5-phosphane.
What is the SMILES notation for difluoromethyl-bis(phenylmethoxy)-sulfanylidene-lambda5-phosphane?
The canonical SMILES for difluoromethyl-bis(phenylmethoxy)-sulfanylidene-lambda5-phosphane is FC(F)P(=S)(OCc1ccccc1)OCc1ccccc1.
What is the InChIKey of difluoromethyl-bis(phenylmethoxy)-sulfanylidene-lambda5-phosphane?
The InChIKey is MYXIQNQYNYQGAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15F2O2PS/c16-15(17)20(21,18-11-13-7-3-1-4-8-13)19-12-14-9-5-2-6-10-14/h1-10,15H,11-12H2.
What are the key properties of difluoromethyl-bis(phenylmethoxy)-sulfanylidene-lambda5-phosphane?
difluoromethyl-bis(phenylmethoxy)-sulfanylidene-lambda5-phosphane has a molecular weight of 328.32 g/mol, XLogP of 4.95, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for difluoromethyl-bis(phenylmethoxy)-sulfanylidene-lambda5-phosphane is sourced from PubChem (CID 15273575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).